propan-2-yl {[3-(4-bromophenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}acetate
Chemical Structure Depiction of
propan-2-yl {[3-(4-bromophenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}acetate
propan-2-yl {[3-(4-bromophenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}acetate
Compound characteristics
| Compound ID: | G856-6220 |
| Compound Name: | propan-2-yl {[3-(4-bromophenyl)-4-methyl-2-oxo-2H-1-benzopyran-6-yl]oxy}acetate |
| Molecular Weight: | 431.28 |
| Molecular Formula: | C21 H19 Br O5 |
| Smiles: | CC(C)OC(COc1ccc2c(c1)C(C)=C(C(=O)O2)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7587 |
| logD: | 4.7587 |
| logSw: | -4.6584 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.225 |
| InChI Key: | ILFCTFTVCHLDEI-UHFFFAOYSA-N |